methyl 1-(2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-2-oxoethyl)-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-(2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-2-oxoethyl)-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
methyl 1-(2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-2-oxoethyl)-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E222-0247 |
| Compound Name: | methyl 1-(2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-2-oxoethyl)-5-(furan-2-yl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C24 H27 N3 O4 |
| Smiles: | COC(c1ccc(c2ccco2)n1CC(NCCCN1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9017 |
| logD: | 1.6977 |
| logSw: | -3.1485 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.881 |
| InChI Key: | ARVBHFVRNUXASJ-UHFFFAOYSA-N |